2-[[(4-chlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-chlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-benzhydryl-2-[[(4-chlorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxamide CAS Name: 2-[[[(4-chloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-(diphenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzhydryl-2-[[(4-chlorophenyl)carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-benzhydryl-2-[[(4-chlorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxamide Formula: C28H27ClN4O2S MolecularWeight: 519.05758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H27ClN4O2S/c1-19(2)33(28(35)30-23-15-13-22(29)14-16-23)17-25-31-24(18-36-25)27(34)32-26(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-16,18-19,26H,17H2,1-2H3,(H,30,35)(H,32,34)